About 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol
4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol (PubChem CID 58720488) has the molecular formula C19H16O2
and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol.
Molecular Properties
| Compound Name | 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol |
| PubChem CID | 58720488 |
| Molecular Formula | C19H16O2 |
| Molecular Weight | 276.34 g/mol |
| Exact Mass | 276.12 |
| IUPAC Name | 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol |
| SMILES | Oc1ccc(Cc2ccc(-c3ccc(O)cc3)cc2)cc1 |
| InChI | InChI=1S/C19H16O2/c20-18-9-3-15(4-10-18)13-14-1-5-16(6-2-14)17-7-11-19(21)12-8-17/h1-12,20-21H,13H2 |
| InChIKey | HHKRTRJJUZZRFJ-UHFFFAOYSA-N |
| XLogP | 4.36 |
| TPSA | 40.46 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 276.34 |
| LogP ≤ 5 | 4.36 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol?
The IUPAC name of 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol (CID 58720488) is 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol.
What is the SMILES notation for 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol?
The canonical SMILES for 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol is Oc1ccc(Cc2ccc(-c3ccc(O)cc3)cc2)cc1.
What is the InChIKey of 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol?
The InChIKey is HHKRTRJJUZZRFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O2/c20-18-9-3-15(4-10-18)13-14-1-5-16(6-2-14)17-7-11-19(21)12-8-17/h1-12,20-21H,13H2.
What are the key properties of 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol?
4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol has a molecular weight of 276.34 g/mol, XLogP of 4.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol is sourced from PubChem (CID 58720488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).